3-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]propanoic acid

Systemtic Name: 3-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]propanoic acid Openeye Name: 3-(3-benzyl-4-oxo-quinazolin-2-yl)propanoic acid CAS Name: 3-[4-oxo-3-(phenylmethyl)-2-quinazolinyl]propanoic acid IUPAC Name: 3-(3-benzyl-4-oxoquinazolin-2-yl)propanoic acid Traditional Name: 3-(3-benzyl-4-keto-quinazolin-2-yl)propionic acid Formula: C18H16N2O3 MolecularWeight: 308.33124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NC3=CC=CC=C3C2=O)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NC3=CC=CC=C3C2=O)CCC(=O)O

InChI

InChI=1S/C18H16N2O3/c21-17(22)11-10-16-19-15-9-5-4-8-14(15)18(23)20(16)12-13-6-2-1-3-7-13/h1-9H,10-12H2,(H,21,22)